2-(2-adamantyl)-1-benzyl-1-phenylhydrazine;hydrochloride

C23H29ClN2 — CID 70527531

IUPAC2-(2-adamantyl)-1-benzyl-1-phenylhydrazine;hydrochloride
SMILESCl.c1ccc(CN(NC2C3CC4CC(C3)CC2C4)c2ccccc2)cc1
InChIInChI=1S/C23H28N2.ClH/c1-3-7-17(8-4-1)16-25(22-9-5-2-6-10-22)24-23-20-12-18-11-19(14-20)15-21(23)13-18;/h1-10,18-21,23-24H,11-16H2;1H
InChIKeyYNWJAHFKIUXJJD-UHFFFAOYSA-N
MW368.95 g/mol
LogP5.44
Rot. Bonds5

About 2-(2-adamantyl)-1-benzyl-1-phenylhydrazine;hydrochloride

2-(2-adamantyl)-1-benzyl-1-phenylhydrazine;hydrochloride (PubChem CID 70527531) has the molecular formula C23H29ClN2 and a molecular weight of 368.95 g/mol. Its IUPAC name is 2-(2-adamantyl)-1-benzyl-1-phenylhydrazine;hydrochloride.

Molecular Properties

Compound Name2-(2-adamantyl)-1-benzyl-1-phenylhydrazine;hydrochloride
PubChem CID70527531
Molecular FormulaC23H29ClN2
Molecular Weight368.95 g/mol
Exact Mass368.20
IUPAC Name2-(2-adamantyl)-1-benzyl-1-phenylhydrazine;hydrochloride
SMILESCl.c1ccc(CN(NC2C3CC4CC(C3)CC2C4)c2ccccc2)cc1
InChIInChI=1S/C23H28N2.ClH/c1-3-7-17(8-4-1)16-25(22-9-5-2-6-10-22)24-23-20-12-18-11-19(14-20)15-21(23)13-18;/h1-10,18-21,23-24H,11-16H2;1H
InChIKeyYNWJAHFKIUXJJD-UHFFFAOYSA-N
XLogP5.44
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.95
LogP ≤ 55.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-phenylmethoxyadamantan-2-amine
CID 15552592
2-(2-adamantylamino)-3-phenylpropan-1-ol
CID 63260809
1-(2-adamantyl)-2-phenylhydrazine
CID 13349717
N-benzyladamantane-2-carboxamide
CID 51191471
2-[1-(2-benzyl-2-phenylhydrazinyl)ethyl]-5,5-dimethylcyclohexane-1,3-dione
CID 5012877
N-(2-adamantyl)-N'-phenylethane-1,2-diamine
CID 6480553
N-phenylmethoxytricyclo[3.3.1.03,7]nonan-2-amine
CID 140552590
N,N-dibenzylaniline
CID 139071697
N-benzyl-N-phenylbicyclo[2.2.1]heptane-2-carboxamide
CID 75853875
2-(1-adamantyl)-1-benzyl-1-(2-phenylethyl)hydrazine
CID 90870934
N'-benzyl-2,2,2-trifluoro-N'-phenylacetohydrazide
CID 71671643
N-(1-phenylethyl)adamantan-2-amine
CID 43405877

Frequently Asked Questions

What is the IUPAC name of 2-(2-adamantyl)-1-benzyl-1-phenylhydrazine;hydrochloride?
The IUPAC name of 2-(2-adamantyl)-1-benzyl-1-phenylhydrazine;hydrochloride (CID 70527531) is 2-(2-adamantyl)-1-benzyl-1-phenylhydrazine;hydrochloride.
What is the SMILES notation for 2-(2-adamantyl)-1-benzyl-1-phenylhydrazine;hydrochloride?
The canonical SMILES for 2-(2-adamantyl)-1-benzyl-1-phenylhydrazine;hydrochloride is Cl.c1ccc(CN(NC2C3CC4CC(C3)CC2C4)c2ccccc2)cc1.
What is the InChIKey of 2-(2-adamantyl)-1-benzyl-1-phenylhydrazine;hydrochloride?
The InChIKey is YNWJAHFKIUXJJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2.ClH/c1-3-7-17(8-4-1)16-25(22-9-5-2-6-10-22)24-23-20-12-18-11-19(14-20)15-21(23)13-18;/h1-10,18-21,23-24H,11-16H2;1H.
What are the key properties of 2-(2-adamantyl)-1-benzyl-1-phenylhydrazine;hydrochloride?
2-(2-adamantyl)-1-benzyl-1-phenylhydrazine;hydrochloride has a molecular weight of 368.95 g/mol, XLogP of 5.44, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-adamantyl)-1-benzyl-1-phenylhydrazine;hydrochloride is sourced from PubChem (CID 70527531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).